0 mol 7 unq 0 iso 0 dist 6.36911 9.87885 7.92429 10.2446 7.45262 8.15894 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.36911 9.87885 7.92429 12.3097 6.96586 8.45544 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.31201 6.1206 4.40641 5.44992 9.55056 8.15894 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.31201 6.1206 4.40641 4.74523 7.57354 8.45544 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 7.31201 7.67927 5.03278 5.44992 9.55056 11.7902 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 7.31201 7.67927 5.03278 4.74523 7.57354 10.3845 numMergedOcc 0
6 mol 7 unq 6 iso 0 dist 9.36807 6.1206 7.92429 5.44992 7.45262 8.15894 numMergedOcc 0
7 mol 7 unq 7 iso 0 dist 9.36807 6.1206 7.92429 4.74523 6.96586 8.45544 numMergedOcc 0
8 mol 7 unq 8 iso 0 dist 9.36807 7.67927 11.2233 5.44992 7.45262 11.7902 numMergedOcc 0
9 mol 7 unq 9 iso 0 dist 9.36807 7.67927 11.2233 4.74523 6.96586 10.3845 numMergedOcc 0
10 mol 9 unq 0 iso 0 dist 8.47421 8.55451 5.66192 3.98483 8.04924 9.64824 numMergedOcc 0
11 mol 9 unq 1 iso 0 dist 8.47421 5.8245 3.91075 3.98483 8.04924 7.05919 numMergedOcc 0
12 mol 39 unq 0 iso 0 dist 7.33969 8.70192 6.58458 11.962 8.19733 12.9411 numMergedOcc 0
13 mol 45 unq 0 iso 0 dist 6.99408 5.94756 4.51883 6.18811 7.95778 7.72462 numMergedOcc 0
14 mol 58 unq 0 iso 0 dist 8.89374 8.96727 14.6599 11.0355 7.93481 19.1756 numMergedOcc 0
15 mol 58 unq 1 iso 0 dist 8.89374 8.01308 9.47022 11.0355 7.93481 15.602 numMergedOcc 0
16 mol 74 unq 0 iso 0 dist 8.96501 7.93281 5.38404 4.79817 4.79413 6.3567 numMergedOcc 0
17 mol 92 unq 0 iso 0 dist 5.81965 8.3773 7.94489 5.7134 9.28578 14.0357 numMergedOcc 0
18 mol 114 unq 0 iso 0 dist 6.73814 5.7144 4.81369 5.6074 8.11094 7.59156 numMergedOcc 0
19 mol 130 unq 0 iso 0 dist 7.66168 9.98797 4.02212 11.576 6.42785 9.6458 numMergedOcc 0
20 mol 130 unq 1 iso 0 dist 7.66168 9.98797 4.02212 4.28797 6.82089 8.24966 numMergedOcc 0
21 mol 130 unq 2 iso 0 dist 9.12581 9.98797 5.46642 4.28797 5.38314 8.24966 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 7.98142 6.64173 4.48306 9.92777 5.49808 9.07638 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 7.98142 9.01624 12.2513 9.92777 5.49808 15.9596 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 7.98142 9.55105 10.2172 9.92777 5.49808 14.193 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 7.37327 6.64173 4.88823 9.92777 7.96291 9.07638 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 7.37327 9.01624 14.8923 9.92777 7.96291 15.9596 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 7.37327 9.55105 14.2334 9.92777 7.96291 14.193 numMergedOcc 0
28 mol 184 unq 0 iso 0 dist 9.52936 8.97589 9.68365 8.41716 6.21206 13.3876 numMergedOcc 0
29 mol 184 unq 1 iso 0 dist 9.52936 5.96423 11.6883 8.41716 6.21206 12.8577 numMergedOcc 0
30 mol 188 unq 0 iso 0 dist 6.90541 7.88013 6.39872 5.48276 7.48284 7.79115 numMergedOcc 0
31 mol 188 unq 1 iso 0 dist 6.90541 9.90062 8.81694 5.48276 7.48284 11.1486 numMergedOcc 0
32 mol 192 unq 0 iso 0 dist 8.36822 9.78634 10.3099 7.0057 8.53433 15.493 numMergedOcc 0
33 mol 192 unq 1 iso 0 dist 8.36822 5.64942 10.1087 7.0057 8.53433 11.7494 numMergedOcc 0
34 mol 192 unq 2 iso 0 dist 8.36822 7.43054 10.0566 7.0057 8.53433 11.7133 numMergedOcc 0
35 mol 205 unq 0 iso 0 dist 9.19704 6.52816 13.4094 5.54129 9.83885 7.53395 numMergedOcc 0
36 mol 205 unq 1 iso 0 dist 9.19704 6.52816 13.4094 5.28092 5.42696 10.183 numMergedOcc 0
37 mol 227 unq 0 iso 0 dist 8.17891 5.23634 4.09934 10.5813 7.1372 9.43618 numMergedOcc 0
38 mol 227 unq 1 iso 0 dist 6.95902 6.91318 4.09934 7.22396 7.1372 9.43618 numMergedOcc 0
39 mol 235 unq 0 iso 0 dist 6.98084 8.19317 4.47008 11.5211 9.31673 9.11454 numMergedOcc 0
40 mol 235 unq 1 iso 0 dist 6.98084 6.29377 7.34601 11.5211 9.31673 11.9508 numMergedOcc 0
41 mol 235 unq 2 iso 0 dist 7.32211 5.1823 4.47008 6.65703 9.31673 9.11454 numMergedOcc 0
42 mol 235 unq 3 iso 0 dist 7.32211 5.70635 7.34601 6.65703 9.31673 11.9508 numMergedOcc 0
43 mol 238 unq 0 iso 0 dist 6.55759 9.12776 15.4844 7.83352 8.6597 12.1568 numMergedOcc 0
44 mol 238 unq 1 iso 0 dist 7.02475 9.12776 13.037 7.83352 7.47235 12.1568 numMergedOcc 0
45 mol 238 unq 2 iso 0 dist 7.67322 9.12776 9.75095 11.0349 7.61203 6.53286 numMergedOcc 0
46 mol 238 unq 3 iso 0 dist 9.68513 8.82351 5.99163 5.87253 9.47845 11.2897 numMergedOcc 0
47 mol 238 unq 4 iso 0 dist 9.29858 9.72188 11.7938 10.7551 9.47845 6.53286 numMergedOcc 0
48 mol 238 unq 5 iso 0 dist 5.9216 8.82351 4.40419 5.87253 6.92409 11.2897 numMergedOcc 0
49 mol 238 unq 6 iso 0 dist 7.19008 9.12776 6.12722 11.0349 6.89694 6.53286 numMergedOcc 0
50 mol 238 unq 7 iso 0 dist 7.19008 9.12776 6.12722 7.83352 6.44735 12.1568 numMergedOcc 0
51 mol 259 unq 0 iso 0 dist 7.48005 9.63573 9.98303 5.60748 6.39918 12.8954 numMergedOcc 0
52 mol 259 unq 1 iso 0 dist 7.48005 7.66153 14.0829 5.60748 6.39918 13.1388 numMergedOcc 0
